SCHEMBL29337017

SCHEMBL29337017

CCC(C)(C)CC1SC(=O)NC1=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HTT P42858 1/20 0.47
MAOA P21397 2/20 0.44
CISD1 Q9NZ45 2/20 0.44
MAOB P27338 1/20 0.41
MAPT P10636 4/20 0.40
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ESR2 Q92731 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CA2 P00918 2/20 0.36
PPARG P37231 7/20 0.36
EPHX2 P34913 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25459923 0.85 TSHR (0.47) TSHRKDM4EHTTMAOACISD1
SCHEMBL12601239 0.82 TSHR (0.52) TSHRKDM4EHTTMAOACISD1
SCHEMBL264929 0.76
SCHEMBL16924077 0.76
SCHEMBL29337016 0.74 EPHX2 (0.44) TSHRKDM4EHTTMAOACISD1
SCHEMBL22623764 0.72 TSHR (0.53) TSHRKDM4EHTTMAOACISD1
SCHEMBL11169825 0.72 TSHR (0.53) TSHRKDM4EHTTMAOACISD1
SCHEMBL11172424 0.71 TSHR (0.52) TSHRKDM4EHTTMAOACISD1
SCHEMBL20150476 0.68 TSHR (0.48) TSHRKDM4EHTTMAOACISD1
SCHEMBL4859372 0.67

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE GENZYME CORPORATION 2024-07-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE CFTR, INMT, IDO1 TSHR 2973/4885KDM4E 4001/4885HTT 553/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.